ethyl 4-[[4-azanyl-5-(2-fluorophenyl)carbonyl-pyrimidin-2-yl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-azanyl-5-(2-fluorophenyl)carbonyl-pyrimidin-2-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-amino-5-(2-fluorobenzoyl)pyrimidin-2-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[4-amino-5-[(2-fluorophenyl)-oxomethyl]-2-pyrimidinyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-amino-5-(2-fluorobenzoyl)pyrimidin-2-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-amino-5-(2-fluorobenzoyl)pyrimidin-2-yl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C19H22FN5O3 MolecularWeight: 387.408083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=NC=C(C(=N2)N)C(=O)C3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=NC=C(C(=N2)N)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C19H22FN5O3/c1-2-28-19(27)25-9-7-12(8-10-25)23-18-22-11-14(17(21)24-18)16(26)13-5-3-4-6-15(13)20/h3-6,11-12H,2,7-10H2,1H3,(H3,21,22,23,24)